2-(2-azanylidene-3-butyl-benzimidazol-1-yl)-1-(5-nitrofuran-2-yl)ethanone hydrobromide

Systemtic Name: 2-(2-azanylidene-3-butyl-benzimidazol-1-yl)-1-(5-nitrofuran-2-yl)ethanone hydrobromide Openeye Name: 2-(3-butyl-2-imino-benzimidazol-1-yl)-1-(5-nitro-2-furyl)ethanone hydrobromide CAS Name: 2-(3-butyl-2-imino-1-benzimidazolyl)-1-(5-nitro-2-furanyl)ethanone hydrobromide IUPAC Name: 2-(3-butyl-2-iminobenzimidazol-1-yl)-1-(5-nitrofuran-2-yl)ethanone hydrobromide Traditional Name: 2-(3-butyl-2-imino-benzimidazol-1-yl)-1-(5-nitro-2-furyl)ethanone hydrobromide Formula: C17H19BrN4O4 MolecularWeight: 423.26116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N(C1=N)CC(=O)C3=CC=C(O3)[N+](=O)[O-].Br

Isomeric SMILES

CCCCN1C2=CC=CC=C2N(C1=N)CC(=O)C3=CC=C(O3)[N+](=O)[O-].Br

InChI

InChI=1S/C17H18N4O4.BrH/c1-2-3-10-19-12-6-4-5-7-13(12)20(17(19)18)11-14(22)15-8-9-16(25-15)21(23)24;/h4-9,18H,2-3,10-11H2,1H3;1H